General Information of the Compound
| Compound ID |
CP0508468
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| Compound Name |
N-(5,6-dimethoxypyrimidin-4-yl)-4-[[(Z)-3-oxo-3-(2-oxochromen-3-yl)prop-1-enyl]amino]benzenesulfonamide
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| Structure |
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| Formula |
C24H20N4O7S
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| Molecular Weight |
508.512
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| Canonical SMILES |
COc1ncnc(NS(=O)(=O)c2ccc(N\C=C/C(=O)c3cc4ccccc4oc3=O)cc2)c1OC
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| InChI |
InChI=1S/C24H20N4O7S/c1-33-21-22(26-14-27-23(21)34-2)28-36(31,32)17-9-7-16(8-10-17)25-12-11-19(29)18-13-15-5-3-4-6-20(15)35-24(18)30/h3-14,25H,1-2H3,(H,26,27,28)/b12-11-
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| InChIKey |
DIOXZBCBHCTVCC-QXMHVHEDSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound